%chk=000147102.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147102

0 1
 O    1.824800     -3.8800001E-02  -2.155100    
 O    5.624000      -2.285200      0.5060000    
 N  -0.3883000      0.3564000     -0.3961000    
 C   0.9711000      0.1553000      0.1209000    
 C    2.000500      0.6559000     -0.9173000    
 C   -1.370700     -0.1626000      0.5395000    
 C   -2.783200      4.2800002E-02 -5.7000001E-03
 C    3.439400      0.4440000     -0.4980000    
 C    1.081000      0.8898000       1.458400    
 C   -3.832600     -0.5176000      0.9576000    
 C    3.871200     -0.8334000     -0.1869000    
 C    4.291200       1.533000     -0.4353000    
 C   -5.233600     -0.2891000      0.4506000    
 C    5.197500      -1.028000      0.1992000    
 C    6.070400      5.7799999E-02  0.2679000    
 C    5.617100       1.338300     -4.9300000E-02
 C   -5.902900      0.8749000      0.7986000    
 C   -5.831100      -1.246100     -0.3562000    
 C    7.492700     -0.1317000      0.6803000    
 C   -7.199300       1.086600      0.3293000    
 C   -7.127600      -1.034200     -0.8256000    
 C   -7.811600      0.1321000     -0.4828000    
 H    1.118000     -0.9191000      0.2898000    
 H    1.823000       1.718200      -1.127000    
 H  -0.4863000     -0.1114000      -1.296600    
 H   -1.342800      0.3583000       1.500900    
 H   -1.203500      -1.231100      0.7221000    
 H   -2.881100     -0.4488000     -0.9826000    
 H   -2.963400       1.113100     -0.1721000    
 H    2.122300      0.9526000       1.791800    
 H   0.7054000       1.917600       1.392600    
 H   0.5562000      0.3716000       2.267400    
 H   -3.667800      -1.591900       1.111600    
 H   -3.723400     -5.5300001E-02   1.947300    
 H    3.198700      -1.684000     -0.2506000    
 H    3.949600       2.534500     -0.6793000    
 H    1.437300     -0.9110000      -1.970900    
 H    6.284200       2.194900     -3.0000001E-04
 H   -5.433900       1.625200       1.428800    
 H   -5.306100      -2.156600     -0.6304000    
 H    8.001300     -0.8134000     -9.6000005E-03
 H    8.048500      0.8121000      0.6795000    
 H    7.543000     -0.5429000       1.694000    
 H   -7.731800       1.995000      0.5955000    
 H   -7.604200      -1.777100      -1.458500    
 H   -8.820900      0.2971000     -0.8485000    
 H    4.883100      -2.906600      0.4031000    


%chk=000147102-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000147102

0 1
O 1.468382 0.126255 -1.897854
O 5.780228 -2.280220 0.495708
N -0.420249 0.473261 0.084577
C 0.966441 0.219489 0.531024
C 1.903777 0.728951 -0.597862
C -1.487260 -0.175997 0.870351
C -2.863832 0.064757 0.219885
C 3.386484 0.490301 -0.365844
C 1.270709 0.937178 1.863305
C -4.018798 -0.610503 1.009374
C 3.871153 -0.799111 -0.017456
C 4.320362 1.536843 -0.544028
C -5.378232 -0.370209 0.368915
C 5.256246 -1.019073 0.145390
C 6.207089 0.024460 -0.029640
C 5.703945 1.299490 -0.374404
C -6.141918 0.781170 0.693424
C -5.894971 -1.268408 -0.600648
C 7.684119 -0.247825 0.154709
C -7.383601 1.030819 0.066584
C -7.135967 -1.024021 -1.231386
C -7.885473 0.128544 -0.900096
H 1.152031 -0.880136 0.673399
H 1.707788 1.808016 -0.730529
H -0.495879 0.242665 -0.918336
H -1.496787 0.247367 1.894241
H -1.323757 -1.281332 0.985132
H -2.859498 -0.323389 -0.819487
H -3.042389 1.154150 0.148588
H 2.312543 0.759643 2.183246
H 1.109635 2.024410 1.749194
H 0.604774 0.577748 2.667499
H -3.817486 -1.698218 1.075050
H -4.013307 -0.219853 2.046317
H 3.166325 -1.626233 0.147790
H 3.964710 2.535351 -0.820736
H 2.059161 -0.643495 -2.097900
H 6.415234 2.121852 -0.514367
H -5.760955 1.484623 1.444766
H -5.321260 -2.167649 -0.859328
H 8.035907 -1.027351 -0.545907
H 8.278655 0.666712 -0.009289
H 7.894628 -0.628473 1.170982
H -7.960094 1.924339 0.332926
H -7.519401 -1.731486 -1.975794
H -8.849201 0.319283 -1.385708
H 5.055389 -2.943496 0.612224


